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Machine learning of scalar molecular properties such as potential energy has enabled widespread applications. However, there are relatively few machine learning models targeting directional properties, including permanent and transition…

Chemical Physics · Physics 2021-11-10 Yaolong Zhang , Jun Jiang , Bin Jiang

The problem of classifying turbulent environments from partial observation is key for some theoretical and applied fields, from engineering to earth observation and astrophysics, e.g. to precondition searching of optimal control policies in…

Fluid Dynamics · Physics 2022-10-19 Michele Buzzicotti , Fabio Bonaccorso

Simulations of complex physical systems are typically realized by discretizing partial differential equations (PDEs) on unstructured meshes. While neural networks have recently been explored for surrogate and reduced order modeling of PDE…

Machine Learning · Computer Science 2021-10-27 Jiayang Xu , Aniruddhe Pradhan , Karthik Duraisamy

Many types of data from fields including natural language processing, computer vision, and bioinformatics, are well represented by discrete, compositional structures such as trees, sequences, or matchings. Latent structure models are a…

Machine Learning · Computer Science 2026-02-04 Vlad Niculae , Caio F. Corro , Nikita Nangia , Tsvetomila Mihaylova , André F. T. Martins

Much attention has been devoted to the use of machine learning to approximate physical concepts. Yet, due to challenges in interpretability of machine learning techniques, the question of what physics machine learning models are able to…

Herding defines a deterministic dynamical system at the edge of chaos. It generates a sequence of model states and parameters by alternating parameter perturbations with state maximizations, where the sequence of states can be interpreted…

Machine Learning · Statistics 2016-03-02 Yutian Chen , Max Welling

In Natural Language Processing (NLP), predicting linguistic structures, such as parsing and chunking, has mostly relied on manual annotations of syntactic structures. This paper introduces an unsupervised approach to chunking, a syntactic…

Computation and Language · Computer Science 2025-12-19 Zijun Wu , Anup Anand Deshmukh , Yongkang Wu , Jimmy Lin , Lili Mou

Connections between integration along hypersufaces, Radon transforms, and neural networks are exploited to highlight an integral geometric mathematical interpretation of neural networks. By analyzing the properties of neural networks as…

Machine Learning · Statistics 2019-07-05 Soheil Kolouri , Xuwang Yin , Gustavo K. Rohde

In this work we explore the application of deep neural networks to the optimization of atomic layer deposition processes based on thickness values obtained at different points of an ALD reactor. We introduce a dataset designed to train…

Machine Learning · Computer Science 2024-06-19 Angel Yanguas-Gil , Jeffrey W. Elam

Polynomial regression is a recurrent problem with a large number of applications. In computer vision it often appears in motion analysis. Whatever the application, standard methods for regression of polynomial models tend to deliver biased…

Computer Vision and Pattern Recognition · Computer Science 2018-05-24 Juan-Manuel Perez-Rua , Tomas Crivelli , Patrick Bouthemy , Patrick Perez

Learning from data has led to a paradigm shift in computational materials science. In particular, it has been shown that neural networks can learn the potential energy surface and interatomic forces through examples, thus bypassing the…

Strongly Correlated Electrons · Physics 2019-02-18 Jianhua Ma , Puhan Zhang , Yaohua Tan , Avik W. Ghosh , Gia-Wei Chern

Large-scale deep neural networks consume expensive training costs, but the training results in less-interpretable weight matrices constructing the networks. Here, we propose a mode decomposition learning that can interpret the weight…

Machine Learning · Computer Science 2023-04-13 Chan Li , Haiping Huang

Entanglement is a key quantity for characterizing quantum correlations in particle scattering processes, but its direct evaluation is computationally demanding on quantum hardware. In this work, we investigate whether fermion density…

Quantum Physics · Physics 2026-04-08 Hala Elhag , Yahui Chai

Information of localization properties of eigenvectors of the complex network has applicability in many different areas which include networks centrality measures, spectral partitioning, development of approximation algorithms, and disease…

Physics and Society · Physics 2021-09-29 Priodyuti Pradhan , Sarika Jalan

Machine learning has proven to be a valuable tool to approximate functions in high-dimensional spaces. Unfortunately, analysis of these models to extract the relevant physics is never as easy as applying machine learning to a large dataset…

Materials Science · Physics 2020-05-06 Conrad W. Rosenbrock , Eric R. Homer , Gábor Csányi , Gus L. W. Hart

Deep neural networks need a big amount of training data, while in the real world there is a scarcity of data available for training purposes. To resolve this issue unsupervised methods are used for training with limited data. In this…

Computer Vision and Pattern Recognition · Computer Science 2022-02-10 Sayed Hashim , Muhammad Ali

Modern machine learning is driving a paradigm shift in particle physics phenomenology at the Large Hadron Collider. This short review examines the transformative role of machine learning across the entire theoretical prediction pipeline,…

High Energy Physics - Phenomenology · Physics 2026-02-04 Maria Ubiali

The results of a Machine Learning-based method is presented here to investigate the scaling properties of the final state charged hadron and mean jet multiplicity distributions. Deep residual neural network architectures with different…

High Energy Physics - Phenomenology · Physics 2022-10-20 Gábor Bíró , Bence Tankó-Bartalis , Gergely Gábor Barnaföldi

Current research in Computer Vision has shown that Convolutional Neural Networks (CNN) give state-of-the-art performance in many classification tasks and Computer Vision problems. The embedding of CNN, which is the internal representation…

Computer Vision and Pattern Recognition · Computer Science 2015-08-04 Axel Angel

The detection of phase transitions is a fundamental challenge in condensed matter physics, traditionally addressed through analytical methods and direct numerical simulations. In recent years, machine learning techniques have emerged as…

Disordered Systems and Neural Networks · Physics 2025-01-14 Djenabou Bayo , Burak Çivitcioğlu , Joseph J Webb , Andreas Honecker , Rudolf A. Römer